[4-(3-fluorophenyl)sulfonylpiperazin-1-yl]-[5-methoxy-4-(2-methoxyethoxy)-2-nitro-phenyl]methanone

Systemtic Name: [4-(3-fluorophenyl)sulfonylpiperazin-1-yl]-[5-methoxy-4-(2-methoxyethoxy)-2-nitro-phenyl]methanone Openeye Name: [4-(3-fluorophenyl)sulfonylpiperazin-1-yl]-[5-methoxy-4-(2-methoxyethoxy)-2-nitro-phenyl]methanone CAS Name: [4-(3-fluorophenyl)sulfonyl-1-piperazinyl]-[5-methoxy-4-(2-methoxyethoxy)-2-nitrophenyl]methanone IUPAC Name: [4-(3-fluorophenyl)sulfonylpiperazin-1-yl]-[5-methoxy-4-(2-methoxyethoxy)-2-nitrophenyl]methanone Traditional Name: [4-(3-fluorophenyl)sulfonylpiperazino]-[5-methoxy-4-(2-methoxyethoxy)-2-nitro-phenyl]methanone Formula: C21H24FN3O8S MolecularWeight: 497.493963

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COCCOC1=C(C=C(C(=C1)[N+](=O)[O-])C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC(=C3)F)OC

Isomeric SMILES

COCCOC1=C(C=C(C(=C1)[N+](=O)[O-])C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC(=C3)F)OC

InChI

InChI=1S/C21H24FN3O8S/c1-31-10-11-33-20-14-18(25(27)28)17(13-19(20)32-2)21(26)23-6-8-24(9-7-23)34(29,30)16-5-3-4-15(22)12-16/h3-5,12-14H,6-11H2,1-2H3